1-[2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]octan-1-one

Systemtic Name: 1-[2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]octan-1-one Openeye Name: 1-[2-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]octan-1-one CAS Name: 1-[2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-1-octanone IUPAC Name: 1-[2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]octan-1-one Traditional Name: 1-[2-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]pyrrolidino]octan-1-one Formula: C21H29N3O2 MolecularWeight: 355.47386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCCC1C2=NC(=NO2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCC(=O)N1CCCC1C2=NC(=NO2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H29N3O2/c1-3-4-5-6-7-10-19(25)24-15-8-9-18(24)21-22-20(23-26-21)17-13-11-16(2)12-14-17/h11-14,18H,3-10,15H2,1-2H3